%chk=000033559.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033559

0 1
 N    4.493200     -0.5787000      0.8758000    
 N   -4.994000      -1.353600      0.9894000    
 C  -0.4656000       1.367600      -1.127700    
 C   0.8553000      0.8490000     -0.5941000    
 C   -1.652200      0.6547000     -0.5727000    
 C    1.495400     -0.1769000      -1.264400    
 C    1.387500       1.414900      0.5496000    
 C    3.264500     -9.6600004E-02  0.3789000    
 C   -2.261100       1.117000      0.5939000    
 C   -2.153300     -0.4744000      -1.220500    
 C    2.710700     -0.6540000     -0.7736000    
 C    2.602800      0.9379000       1.040500    
 C   -3.371000      0.4503000       1.112800    
 C   -3.263100      -1.141300     -0.7016000    
 C   -3.872000     -0.6789000      0.4650000    
 C    5.223100      -1.636900      0.2488000    
 H  -0.4679000       1.304400      -2.224900    
 H  -0.5452000       2.444900     -0.9251000    
 H    1.072200     -0.6164000      -2.162900    
 H   0.8803000       2.221200       1.071200    
 H   -1.881900       1.995900       1.108500    
 H   -1.689400     -0.8452000      -2.130700    
 H    3.192900      -1.460100      -1.318600    
 H    3.023700       1.380900       1.939600    
 H   -3.836700      0.8204000       2.022600    
 H   -3.644200      -2.020100      -1.215700    
 H    4.864800     -0.1496000       1.715600    
 H    5.523700      -1.371500     -0.7701000    
 H    4.648000      -2.568600      0.2309000    
 H    6.139400      -1.833700      0.8151000    
 H   -5.357800      -2.172000      0.5197000    
 H   -5.436400      -1.018700       1.835000    


%chk=000033559-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000033559

0 1
N 4.585028 -0.930240 0.798953
N -5.330678 -0.979684 1.103803
C -0.446733 1.274505 -1.078837
C 0.865644 0.663014 -0.591299
C -1.716262 0.678893 -0.469501
C 1.872552 0.261329 -1.500323
C 1.137857 0.508767 0.795409
C 3.374804 -0.412501 0.326748
C -2.764938 1.509671 -0.002930
C -1.909008 -0.725003 -0.387691
C 3.108181 -0.267914 -1.064969
C 2.360203 -0.013117 1.250601
C -3.961887 0.974598 0.517818
C -3.096420 -1.278487 0.127483
C -4.148570 -0.434644 0.589427
C 5.671411 -1.366898 -0.070407
H -0.484977 1.173914 -2.183216
H -0.446483 2.365602 -0.877028
H 1.691060 0.362300 -2.578604
H 0.370578 0.795652 1.524862
H -2.645906 2.600262 -0.046912
H -1.107899 -1.393312 -0.726242
H 3.857380 -0.568155 -1.804573
H 2.541991 -0.118842 2.328600
H -4.754097 1.646191 0.872614
H -3.215845 -2.368521 0.177161
H 4.702642 -1.016009 1.805984
H 6.049932 -0.541158 -0.708118
H 5.361553 -2.195890 -0.740777
H 6.510654 -1.727707 0.547470
H -5.462760 -1.985266 1.148689
H -6.083309 -0.379451 1.426106


